Sodium ion → 5-(2-Isopropyl-5-isothiocyanato-4-methoxy-phenoxy)-pyrimidine-2,4-diamine
Reaction equation
[Cl:29][C:30]([Cl:31])=[S:32].[F:22][C:23]([F:24])([F:25])[C:26]([OH:27])=[O:28].[NH2:1][c:2]1[c:3]([O:20][CH3:21])[cH:4][c:5]([CH:17]([CH3:18])[CH3:19])[c:6]([O:7][c:8]2[c:9]([NH2:15])[n:10][c:11]([NH2:14])[n:12][cH:13]2)[cH:16]1.[Na+:34].[OH-:33].[OH2:35]>>[N:1]([c:2]1[c:3]([O:20][CH3:21])[cH:4][c:5]([CH:17]([CH3:18])[CH3:19])[c:6]([O:7][c:8]2[c:9]([NH2:15])[n:10][c:11]([NH2:14])[n:12][cH:13]2)[cH:16]1)=[C:30]=[S:32]Participants
7
Sources & evidence
- ORD record
- ord-ebdf02c209e240ebab3960dea6537748
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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